element(s):
['Cr', 'Ni']
AFLOW prototype label:
AB3_cF16_225_a_bc
Parameter names:
['a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['5.7577']
model name:
MEAM_LAMMPS_ChoiJoSohn_2018_CoNiCrFeMn__MO_115454747503_001
==== Building ASE atoms object with: ====
representative atom symbols =  ['Cr', 'Ni', 'Ni']
representative atom coordinates =  [[0.   0.   0.  ]
 [0.5  0.5  0.5 ]
 [0.25 0.25 0.25]]
spacegroup =  225
cell =  [[5.7577, 0, 0], [0, 5.7577, 0], [0, 0, 5.7577]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 15:59:36      -67.367468         0.833880
BFGS:    1 15:59:36      -67.396868         0.811387
BFGS:    2 15:59:36      -67.511360         0.714503
BFGS:    3 15:59:36      -67.611014         0.613518
BFGS:    4 15:59:37      -67.695204         0.508301
BFGS:    5 15:59:37      -67.763286         0.398717
BFGS:    6 15:59:37      -67.814594         0.284625
BFGS:    7 15:59:37      -67.848441         0.165883
BFGS:    8 15:59:37      -67.864119         0.042341
BFGS:    9 15:59:37      -67.865180         0.001131
BFGS:   10 15:59:37      -67.865181         0.000007
BFGS:   11 15:59:37      -67.865181         0.000000
Minimization converged after 11 steps.
Maximum force component: 1.3258891481874796e-30 eV/Angstrom
Maximum stress component: 1.1371097294623383e-10 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Cr', 'Cr', 'Cr', 'Cr', 'Ni', 'Ni', 'Ni', 'Ni', 'Ni', 'Ni', 'Ni', 'Ni', 'Ni', 'Ni', 'Ni', 'Ni']
basis =  [[0.00000000e+00 0.00000000e+00 0.00000000e+00]
 [6.69444457e-49 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 0.00000000e+00 5.00000000e-01]
 [5.00000000e-01 5.00000000e-01 0.00000000e+00]
 [5.00000000e-01 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 2.43434348e-49 0.00000000e+00]
 [4.86868696e-49 5.00000000e-01 0.00000000e+00]
 [2.43434348e-49 0.00000000e+00 5.00000000e-01]
 [2.50000000e-01 2.50000000e-01 2.50000000e-01]
 [7.50000000e-01 7.50000000e-01 2.50000000e-01]
 [7.50000000e-01 2.50000000e-01 7.50000000e-01]
 [2.50000000e-01 7.50000000e-01 7.50000000e-01]
 [2.50000000e-01 2.50000000e-01 7.50000000e-01]
 [7.50000000e-01 7.50000000e-01 7.50000000e-01]
 [2.50000000e-01 7.50000000e-01 2.50000000e-01]
 [7.50000000e-01 2.50000000e-01 2.50000000e-01]]
cellpar =  Cell([[5.621456226646109, -1.3524572535633524e-32, 2.580990623781012e-32], [-4.653321451110196e-33, 5.621456226646109, 1.8139723749430463e-18], [-2.1179893422217716e-32, 1.813972374943051e-18, 5.621456226646109]])
forces =  [[ 0.00000000e+00  0.00000000e+00  0.00000000e+00]
 [ 0.00000000e+00  0.00000000e+00  0.00000000e+00]
 [ 0.00000000e+00  0.00000000e+00  0.00000000e+00]
 [ 0.00000000e+00  0.00000000e+00  0.00000000e+00]
 [ 0.00000000e+00  0.00000000e+00  0.00000000e+00]
 [ 0.00000000e+00  0.00000000e+00  0.00000000e+00]
 [ 0.00000000e+00  0.00000000e+00  0.00000000e+00]
 [ 0.00000000e+00  0.00000000e+00  0.00000000e+00]
 [-3.06029939e-31  1.27031296e-31 -7.02822296e-31]
 [ 8.80557845e-32 -2.42514292e-31 -6.17834029e-31]
 [-3.98957663e-31  4.79254434e-31  9.00767369e-31]
 [ 1.09708846e-31 -5.08125183e-31  1.28763541e-30]
 [-6.92897976e-32  3.57997288e-31  8.19929272e-31]
 [ 5.29417360e-31 -4.18625861e-32  8.31477571e-31]
 [ 5.31221782e-31 -5.60814299e-31 -6.28660560e-31]
 [-2.02817012e-31  2.19417692e-31 -1.32588915e-30]]
stress =  [1.13710973e-10 1.13710973e-10 1.13710973e-10 3.68042331e-27
 5.20069673e-34 1.29696470e-51]
energy per atom =  -4.241573822161497
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0